5-[(2-Aminoethyl)Amino]-2-[2-(Diethylamino)Ethyl]-2H-Thiochromeno[4,3,2-Cd]Indazol-9-Ol

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Properties Simple | Detailed

Formula C21H27N5OS
IUPAC Name 5-[(2-aminoethyl)amino]-2-[2-(diethylamino)ethyl]-2h-thiochromeno[4,3,2-cd]indazol-9-ol
Molecular Mass 397.537 g·mol−1
Heat of Formation 174.4 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 479.46 Å 3
Surface Area 420.92 Å 2
HOMO Energy -7.38 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-(1)benzothiopyrano(4,3,2-cd)indazol-9-ol, 5-((2-aminoethyl)amino)-2-(2-(diethylamino)ethyl)-
  • pd 121373
CAS Number(s)
  • 113457-06-0
InChIKey UXIMOIBPXBNYNC-UHFFFAOYSA-N
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